SCHEMBL6405505

SCHEMBL6405505

CC(=O)CCn1ncc(Cl)c(Cl)c1=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 15/20 0.57
▸ ALDH1A1 P00352 14/20 0.57
▸ MITF O75030 8/20 0.57
▸ NPC1 O15118 8/20 0.57
▸ SMN1; SMN2 Q16637 7/20 0.57
▸ MAPT P10636 9/20 0.51
▸ S1PR4 O95977 3/20 0.51
▸ S1PR1 P21453 3/20 0.51
▸ TP53 P04637 1/20 0.51
▸ RAB9A P51151 14/20 0.50
▸ NPSR1 Q6W5P4 10/20 0.50
▸ LMNA P02545 10/20 0.50
▸ POLB P06746 4/20 0.50
▸ RECQL P46063 3/20 0.50
▸ S1PR2 O95136 3/20 0.49
▸ PKM P14618 2/20 0.49
▸ CYP1A2 P05177 2/20 0.49
▸ CYP2C19 P33261 2/20 0.49
▸ HCRTR1 O43613 1/20 0.49
▸ HSP90AA1 P07900 1/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10876189 0.85 HTT (0.55) HTTALDH1A1MITFNPC1SMN1; SMN2
SCHEMBL9194366 0.85 HTT (0.55) HTTALDH1A1MITFNPC1SMN1; SMN2
SCHEMBL20111044 0.83 ALDH1A1 (0.54) HTTALDH1A1MITFNPC1SMN1; SMN2
SCHEMBL29451993 0.81 ALDH1A1 (0.53) HTTALDH1A1MITFNPC1SMN1; SMN2
SCHEMBL31735821 0.80 ALDH1A1 (0.54) HTTALDH1A1MITFNPC1SMN1; SMN2
SCHEMBL9827518 0.80 ALDH1A1 (0.57) HTTALDH1A1MITFNPC1SMN1; SMN2
SCHEMBL9763242 0.80 HTT (0.55) HTTALDH1A1MITFNPC1SMN1; SMN2
SCHEMBL9234092 0.80 HTT (0.57) HTTALDH1A1MITFNPC1SMN1; SMN2
SCHEMBL14574536 0.79 HTT (0.56) HTTALDH1A1MITFNPC1SMN1; SMN2
SCHEMBL10360715 0.78 HTT (0.54) HTTALDH1A1MITFNPC1SMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2638179-B1 NON METAL TANNING STAHL INT BV (NL) 2014-11-26 — — EP disclosed
US-8679196-B2 Non metal tanning CLARIANT FINANCE (BVI) LIMITED (VG) 2014-03-25 — — US disclosed
US-8679196-B2 Non metal tanning CLARIANT FINANCE (BVI) LIMITED (VG) 2014-03-25 — — US disclosed
US-20130227799-A1 Non Metal Tanning CLARIANT FINANCE (BVI) LIMITED (VG) 2013-09-05 — — US disclosed
US-20130227799-A1 Non Metal Tanning CLARIANT FINANCE (BVI) LIMITED (VG) 2013-09-05 — — US disclosed
WO-2012062413-A1 NON METAL TANNING CLARIANT INTERNATIONAL LTD (CH) 2012-05-18 — — WO disclosed
US-20070149719-A1 Granular polysaccharide polymer having phthalocyanine skeleton bonded thereto SHOWA DENKO K.K. (JP) 2007-06-28 — — US disclosed
US-20070106033-A1 Crosslinked polymer having phthalocyanine bonded thereto SHOWA DENKO K.K. (JP) 2007-05-10 — — US disclosed
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